Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1183e20ad766667288c4956700a2378c",
"space_group_name": "P 1",
"unit_cell": {
"a": 48.98,
"b": 59.77,
"c": 79.38,
"alpha": 79.84,
"beta": 81.43,
"gamma": 75.99
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [77.650,1.690],
"number_observations": 302983,
"number_observations_unique": 92935,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 12.300
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.690],
"number_observations": 11594,
"number_observations_unique": 6722,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.643
},
{
"type": "R(meas)",
"value": 0.910
},
{
"type": "R(pim)",
"value": 0.643
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.638
}
]
},
{
"resolution_limits": [77.650,7.560],
"number_observations": 3971,
"number_observations_unique": 1060,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 53.500
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}